SCHEMBL6503203

SCHEMBL6503203

CCOC(=O)C(Cc1ccc(OC)c(COCc2ccc(C(F)(F)F)cc2)c1)OC(C)C

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.48
PPARD Q03181 11/20 0.48
PPARG P37231 7/20 0.46
MMP1 P03956 1/20 0.42
FFAR1 O14842 1/20 0.42
FFAR2 O15552 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
MAPT P10636 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6497980 0.89 PPARA (0.54) PPARAPPARDPPARGMMP1
SCHEMBL6493866 0.85 PPARA (0.60) PPARAPPARDPPARG
SCHEMBL6502319 0.84 PPARD (0.69) PPARAPPARDPPARG
SCHEMBL6493850 0.84 PPARA (0.50) PPARAPPARDPPARGMMP1FFAR1
SCHEMBL4329462 0.80 ALOX15 (0.44) PPARAPPARDPPARG
SCHEMBL6506184 0.80 ALOX15 (0.46) PPARAPPARDPPARG
SCHEMBL6494999 0.80 PPARA (0.50) PPARAPPARDPPARGMMP1FFAR1
SCHEMBL6495045 0.79 PPARA (0.72) PPARAPPARDPPARG
SCHEMBL6495710 0.79 PPARA (0.66) PPARAPPARDPPARGMMP1
SCHEMBL4329833 0.79 ALOX15 (0.46) PPARAPPARDPPARG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed